| Properties | Image |
MNX_ID | MNXM213397 |
 |
reference | slm:000021840 |
formula | C38H65O8P |
global charge | -2 |
mol weight | 680.904 |
InChIKey | DHWUBOOTBNGHIA-HFIIMNAOSA-L |
InChI | InChI=1S/C38H67O8P/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-19-23-26-29-32-38(40)46-36(34-45-47(41,42)43)33-44-37(39)31-28-25-22-20-17-18-21-24-27-30-35(2)3/h8-9,11-12,14-15,19,23,35-36H,4-7,10,13,16-18,20-22,24-34H2,1-3H3,(H2,41,42,43)/p-2/b9-8-,12-11-,15-14-,23-19-/t36-/m1/s1 |
SMILES | CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCC(=O)O[C@H](COC(=O)CCCCCCCCCCCC(C)C)COP(=O)([O-])[O-] |
MNX internals
InChI (mnx) | InChI=1/C38H67O8P/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-19-23-26-29-32-38(40)46-36(34-45-47(41,42)43)33-44-37(39)31-28-25-22-20-17-18-21-24-27-30-35(2)3/h8-9,11-12,14-15,19,23,35-36H,4-7,10,13,16-18,20-22,24-34H2,1-3H3,(H2,41,42,43)/b9-8-,12-11-,15-14-,23-19-/t36-/m1/s1 |
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SMILES (mnx) | [CH3:1][CH2:4][CH2:5][CH2:6][CH2:7]/[CH:8]=[CH:9]\[CH2:10]/[CH:11]=[CH:12]\[CH2:13]/[CH:14]=[CH:15]\[CH2:16]/[CH:19]=[CH:23]\[CH2:26][CH2:29][CH2:32][C:38](=[O:40])[O:46][C@H:36]([CH2:33][O:44][C:37]([CH2:31][CH2:28][CH2:25][CH2:22][CH2:20][CH2:17][CH2:18][CH2:21][CH2:24][CH2:27][CH2:30][CH:35]([CH3:2])[CH3:3])=[O:39])[CH2:34][O:45][P:47]([OH:41])([OH:42])=[O:43] |
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